N-[1-[[3-(trifluoromethyl)phenyl]methyl]indazol-3-yl]furan-2-carboxamide

C20H14F3N3O2 — CID 118335612

IUPACN-[1-[[3-(trifluoromethyl)phenyl]methyl]indazol-3-yl]furan-2-carboxamide
SMILESO=C(Nc1nn(Cc2cccc(C(F)(F)F)c2)c2ccccc12)c1ccco1
InChIInChI=1S/C20H14F3N3O2/c21-20(22,23)14-6-3-5-13(11-14)12-26-16-8-2-1-7-15(16)18(25-26)24-19(27)17-9-4-10-28-17/h1-11H,12H2,(H,24,25,27)
InChIKeyLNJSZWGIXXZOGE-UHFFFAOYSA-N
MW385.35 g/mol
LogP4.95
Rot. Bonds4

About N-[1-[[3-(trifluoromethyl)phenyl]methyl]indazol-3-yl]furan-2-carboxamide

N-[1-[[3-(trifluoromethyl)phenyl]methyl]indazol-3-yl]furan-2-carboxamide (PubChem CID 118335612) has the molecular formula C20H14F3N3O2 and a molecular weight of 385.35 g/mol. Its IUPAC name is N-[1-[[3-(trifluoromethyl)phenyl]methyl]indazol-3-yl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[1-[[3-(trifluoromethyl)phenyl]methyl]indazol-3-yl]furan-2-carboxamide
PubChem CID118335612
Molecular FormulaC20H14F3N3O2
Molecular Weight385.35 g/mol
Exact Mass385.10
IUPAC NameN-[1-[[3-(trifluoromethyl)phenyl]methyl]indazol-3-yl]furan-2-carboxamide
SMILESO=C(Nc1nn(Cc2cccc(C(F)(F)F)c2)c2ccccc12)c1ccco1
InChIInChI=1S/C20H14F3N3O2/c21-20(22,23)14-6-3-5-13(11-14)12-26-16-8-2-1-7-15(16)18(25-26)24-19(27)17-9-4-10-28-17/h1-11H,12H2,(H,24,25,27)
InChIKeyLNJSZWGIXXZOGE-UHFFFAOYSA-N
XLogP4.95
TPSA60.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.35
LogP ≤ 54.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-Methyl-N-(1-((4-(trifluoromethyl)phenyl)methyl)-1H-indazol-3-yl)-3-furancarboxamide
CID 91844684
N-[1-(2-methylpropyl)pyrazolo[3,4-b]quinolin-3-yl]furan-2-carboxamide
CID 938552
N-[4-(4-methoxyphenyl)-1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]-2-furamide
CID 2809605
N-(6-methyl-1-propylpyrazolo[3,4-b]quinolin-3-yl)furan-2-carboxamide
CID 934278
N-[6-methyl-1-(2-methylpropyl)-3-pyrazolo[3,4-b]quinolinyl]-2-furancarboxamide
CID 939495
N-[2-methyl-4-phenyl-5-(trifluoromethyl)pyrazol-3-yl]furan-2-carboxamide
CID 2812003
N-(1-ethyl-7-methyl-3-pyrazolo[3,4-b]quinolinyl)-2-furancarboxamide
CID 664852
N-(1-propyl-1H-pyrazolo[3,4-b]quinolin-3-yl)-2-furamide
CID 944687
N-{1-methyl-3-(trifluoromethyl)-4-[3-(trifluoromethyl)phenyl]-1H-pyrazol-5-yl}-2-furamide
CID 2809606
1-(furan-2-ylmethyl)-3-(2-oxo-4-piperidin-4-yl-1H-pyrimido[1,2-b]indazol-10-yl)urea
CID 137066487
N-(1-ethyl-6-methylpyrazolo[3,4-b]quinolin-3-yl)furan-2-carboxamide
CID 943657
N-(1-((4-(trifluoromethyl)phenyl)methyl)-1H-indazol-3-yl)furan-2-carboxamide
CID 73331364

Frequently Asked Questions

What is the IUPAC name of N-[1-[[3-(trifluoromethyl)phenyl]methyl]indazol-3-yl]furan-2-carboxamide?
The IUPAC name of N-[1-[[3-(trifluoromethyl)phenyl]methyl]indazol-3-yl]furan-2-carboxamide (CID 118335612) is N-[1-[[3-(trifluoromethyl)phenyl]methyl]indazol-3-yl]furan-2-carboxamide.
What is the SMILES notation for N-[1-[[3-(trifluoromethyl)phenyl]methyl]indazol-3-yl]furan-2-carboxamide?
The canonical SMILES for N-[1-[[3-(trifluoromethyl)phenyl]methyl]indazol-3-yl]furan-2-carboxamide is O=C(Nc1nn(Cc2cccc(C(F)(F)F)c2)c2ccccc12)c1ccco1.
What is the InChIKey of N-[1-[[3-(trifluoromethyl)phenyl]methyl]indazol-3-yl]furan-2-carboxamide?
The InChIKey is LNJSZWGIXXZOGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14F3N3O2/c21-20(22,23)14-6-3-5-13(11-14)12-26-16-8-2-1-7-15(16)18(25-26)24-19(27)17-9-4-10-28-17/h1-11H,12H2,(H,24,25,27).
What are the key properties of N-[1-[[3-(trifluoromethyl)phenyl]methyl]indazol-3-yl]furan-2-carboxamide?
N-[1-[[3-(trifluoromethyl)phenyl]methyl]indazol-3-yl]furan-2-carboxamide has a molecular weight of 385.35 g/mol, XLogP of 4.95, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[[3-(trifluoromethyl)phenyl]methyl]indazol-3-yl]furan-2-carboxamide is sourced from PubChem (CID 118335612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).